Cargando…
Stereodynamics Study of the Reaction of O((3)P) with CH(4) (v = 0, j = 0)
A new London-Eyring-Polanyi-Sato (LEPS) potential energy surface (PES) is used in the O + CH(4) → OH + CH(3) reaction via the quasiclassical trajectory method (QCT). Comparing with the experiments and the former ab initio calculations, the new LEPS PES describes the actual potential energy surface o...
| Autores principales: | , , , , |
|---|---|
| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Molecular Diversity Preservation International (MDPI)
2009
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2695273/ https://www.ncbi.nlm.nih.gov/pubmed/19564945 http://dx.doi.org/10.3390/ijms10052146 |